4-[(2-oxidanylidene-1,3-benzoxathiol-6-yl)oxy]butanethioamide

Systemtic Name: 4-[(2-oxidanylidene-1,3-benzoxathiol-6-yl)oxy]butanethioamide Openeye Name: 4-[(2-oxo-1,3-benzoxathiol-6-yl)oxy]butanethioamide CAS Name: 4-[(2-oxo-1,3-benzoxathiol-6-yl)oxy]butanethioamide IUPAC Name: 4-[(2-oxo-1,3-benzoxathiol-6-yl)oxy]butanethioamide Traditional Name: 4-[(2-keto-1,3-benzoxathiol-6-yl)oxy]thiobutyramide Formula: C11H11NO3S2 MolecularWeight: 269.33994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OCCCC(=S)N)OC(=O)S2

Isomeric SMILES

C1=CC2=C(C=C1OCCCC(=S)N)OC(=O)S2

InChI

InChI=1S/C11H11NO3S2/c12-10(16)2-1-5-14-7-3-4-9-8(6-7)15-11(13)17-9/h3-4,6H,1-2,5H2,(H2,12,16)